Benzoxazole, 5-chloro-2-(2,2-dimethylacetatamido)-
Basic information
- CAS
64037-19-0- Standard SMILES
CC(C)C(=O)Nc1nc2cc(Cl)ccc2o1- InChIKey
YFQMJRKDDFCXOC-UHFFFAOYSA-N- Molecular formula
- C11H11ClN2O2
- Average molar mass
- 238.67 g/mol
- Monoisotopic mass
- 238.0509053
Names & identifiers
- Preferred name
- Benzoxazole, 5-chloro-2-(2,2-dimethylacetatamido)-
- IUPAC
- N-(5-chloro-1,3-benzoxazol-2-yl)-2-methylpropanamide
- English name
- 2-Methyl-N-(5-chlorobenzoxazol-2-yl)propionamide
- Molecular weight
- 0
Names & synonyms
BRN 098789264037-19-0BENZOXAZOLE, 5-CHLORO-2-(2,2-DIMETHYLACETATAMIDO)-5-Chloro-2-(2,2-dimethylacetatamido)benzoxazoleDTXSID20214041RefChem:328276DTXCID20136532N-(5-chloro-1,3-benzoxazol-2-yl)-2-methylpropanamide2-Methyl-N-(5-chlorobenzoxazol-2-yl)propionamideDB-303611
Database identifiers
- CAS
64037-19-0- PubChem CID
- 46392
- DTXSID
DTXSID20214041- Nikkaji
- J67.901A
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 273
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Compound notes
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